Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Histone deacetylase 1' and Ligand = 'BDBM50314136'   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kJ/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Histone deacetylase 1 (Homo sapiens (Human))	BDBM50314136 (CHEMBL1089339 | N-Hydroxy-N'-(3-methylphenyl)octan...) Show SMILES Cc1cccc(NC(=O)CCCCC(=O)NO)c1 Show InChI InChI=1S/C13H18N2O3/c1-10-5-4-6-11(9-10)14-12(16)7-2-3-8-13(17)15-18/h4-6,9,18H,2-3,7-8H2,1H3,(H,14,16)(H,15,17)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	57	n/a	n/a	n/a	n/a	n/a	n/a
UMR CNRS 6026-Universit£ Rennes 1 Curated by ChEMBL					Assay Description Ex vivo inhibition of human HDAC1 in human Caco2 cells by flurometric cellular activity assay				J Med Chem 53: 1937-50 (2010) Article DOI: 10.1021/jm901561u BindingDB Entry DOI: 10.7270/Q2QJ7HFB
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